SCHEMBL21740555

SCHEMBL21740555

C1=CC2Nc3cccc(-c4ccccc4)c3C2C=C1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRNB2 P17787 1/20 0.36
CHRNA4 P43681 1/20 0.36
DPP4 P27487 1/20 0.34
BRD4 O60885 1/20 0.33
CREBBP Q92793 1/20 0.33
PDCD1 Q15116 1/20 0.31
CD274 Q9NZQ7 1/20 0.31
TNKS2 Q9H2K2 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22544445 0.81 KDM4E (0.33)
SCHEMBL24655979 0.78 ESR1 (0.32)
SCHEMBL7833178 0.75 MEN1 (0.33) CHRNB2CHRNA4
SCHEMBL13639413 0.74 CHRNB2 (0.36) CHRNB2CHRNA4DPP4BRD4CREBBP
SCHEMBL10080214 0.73 TSHR (0.41) TNKS2
SCHEMBL12333958 0.73 TNKS2 (0.37) TNKS2
SCHEMBL24727347 0.71 KDM4E (0.41)
SCHEMBL15704498 0.70 HSPA1A (0.38) TNKS2
SCHEMBL19004692 0.70 HSPA1A (0.38) TNKS2
SCHEMBL454276 0.70 HSPA1A (0.38) TNKS2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3611173-A1 ORGANIC LIGHT EMITTING ELEMENT AND COMPOSITION FOR ORGANIC MATERIAL LAYER IN ORGANIC LIGHT EMITTING ELEMENT Heesung Material Ltd. (KR) 2020-02-19 EP disclosed